6,11-bis(4-methylphenyl)indeno[1,2-c]chromene

C30H22O — CID 71490854

IUPAC6,11-bis(4-methylphenyl)indeno[1,2-c]chromene
SMILESCc1ccc(-c2oc3ccccc3c3c(-c4ccc(C)cc4)c4ccccc4c2-3)cc1
InChIInChI=1S/C30H22O/c1-19-11-15-21(16-12-19)27-23-7-3-4-8-24(23)29-28(27)25-9-5-6-10-26(25)31-30(29)22-17-13-20(2)14-18-22/h3-18H,1-2H3
InChIKeyCVYVAXQTOWFQTL-UHFFFAOYSA-N
MW398.51 g/mol
LogP8.64
Rot. Bonds2

About 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene

6,11-bis(4-methylphenyl)indeno[1,2-c]chromene (PubChem CID 71490854) has the molecular formula C30H22O and a molecular weight of 398.51 g/mol. Its IUPAC name is 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene.

Molecular Properties

Compound Name6,11-bis(4-methylphenyl)indeno[1,2-c]chromene
PubChem CID71490854
Molecular FormulaC30H22O
Molecular Weight398.51 g/mol
Exact Mass398.17
IUPAC Name6,11-bis(4-methylphenyl)indeno[1,2-c]chromene
SMILESCc1ccc(-c2oc3ccccc3c3c(-c4ccc(C)cc4)c4ccccc4c2-3)cc1
InChIInChI=1S/C30H22O/c1-19-11-15-21(16-12-19)27-23-7-3-4-8-24(23)29-28(27)25-9-5-6-10-26(25)31-30(29)22-17-13-20(2)14-18-22/h3-18H,1-2H3
InChIKeyCVYVAXQTOWFQTL-UHFFFAOYSA-N
XLogP8.64
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500398.51
LogP ≤ 58.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene?
The IUPAC name of 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene (CID 71490854) is 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene.
What is the SMILES notation for 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene?
The canonical SMILES for 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene is Cc1ccc(-c2oc3ccccc3c3c(-c4ccc(C)cc4)c4ccccc4c2-3)cc1.
What is the InChIKey of 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene?
The InChIKey is CVYVAXQTOWFQTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22O/c1-19-11-15-21(16-12-19)27-23-7-3-4-8-24(23)29-28(27)25-9-5-6-10-26(25)31-30(29)22-17-13-20(2)14-18-22/h3-18H,1-2H3.
What are the key properties of 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene?
6,11-bis(4-methylphenyl)indeno[1,2-c]chromene has a molecular weight of 398.51 g/mol, XLogP of 8.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,11-bis(4-methylphenyl)indeno[1,2-c]chromene is sourced from PubChem (CID 71490854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).